Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.46 |
| ▸ | PIM1 | P11309 | 1/20 | 0.44 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | EPHX2 | P34913 | 2/20 | 0.43 |
| ▸ | FAAH | O00519 | 1/20 | 0.43 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | DAO | P14920 | 1/20 | 0.41 |
| ▸ | DRD1 | P21728 | 1/20 | 0.41 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL97114 | 0.90 | ALDH1A1 (0.52) | ALDH1A1LMNAMAPTHPGDSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL3539828 | 0.88 | ALDH1A1 (0.50) | ALDH1A1LMNAMAPTHPGDSMN1; SMN2 | |
| SCHEMBL38652385 | 0.87 | RAB9A (0.46) | ALDH1A1LMNAMAPTHPGDSMN1; SMN2 | |
| SCHEMBL13581064 | 0.86 | RAB9A (0.55) | ALDH1A1LMNAMAPTHPGDSMN1; SMN2 | |
| SCHEMBL2092054 | 0.86 | SLC6A4 (0.56) | ALDH1A1MAPTSLC6A4EPHX2GPR84 | |
| SCHEMBL505301 | 0.85 | DRD1 (0.56) | ALDH1A1PIM1PIM2CYP2A6EPHX2 | |
| SCHEMBL1744566 | 0.85 | PARP10 (0.50) | ALDH1A1LMNASMN1; SMN2PIM1PIM2 | |
| SCHEMBL3464472 | 0.85 | CYP2D6 (0.48) | ALDH1A1LMNAMAPTHPGDSMN1; SMN2 | |
| SCHEMBL3464474 | 0.85 | CYP2D6 (0.48) | ALDH1A1LMNAMAPTHPGDSMN1; SMN2 | |
| SCHEMBL9607326 | 0.84 | MAOA (0.44) | SLC6A4PIM1GPR84RAB9ADAO |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012069856-A1 | ANTIMALARIAL COMPOUNDS | LIVERPOOL SCHOOL OF TROPICAL MEDICINE (GB) | 2012-05-31 | — | — | WO | disclosed |